4-[[(3S)-3-[methylsulfonyl(naphthalen-2-yl)amino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]thiophene-2-carboximidamide

Systemtic Name: 4-[[(3S)-3-[methylsulfonyl(naphthalen-2-yl)amino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]thiophene-2-carboximidamide Openeye Name: 4-[[(3S)-3-[methylsulfonyl(2-naphthyl)amino]-2-oxo-pyrrolidin-1-yl]methyl]thiophene-2-carboxamidine CAS Name: 4-[[(3S)-3-[methylsulfonyl(2-naphthalenyl)amino]-2-oxo-1-pyrrolidinyl]methyl]-2-thiophenecarboximidamide IUPAC Name: 4-[[(3S)-3-[methylsulfonyl(naphthalen-2-yl)amino]-2-oxopyrrolidin-1-yl]methyl]thiophene-2-carboximidamide Traditional Name: 4-[[(3S)-2-keto-3-[mesyl(2-naphthyl)amino]pyrrolidino]methyl]thiophene-2-carboxamidine Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1CCN(C1=O)CC2=CSC(=C2)C(=N)N)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CS(=O)(=O)N([C@H]1CCN(C1=O)CC2=CSC(=C2)C(=N)N)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H22N4O3S2/c1-30(27,28)25(17-7-6-15-4-2-3-5-16(15)11-17)18-8-9-24(21(18)26)12-14-10-19(20(22)23)29-13-14/h2-7,10-11,13,18H,8-9,12H2,1H3,(H3,22,23)/t18-/m0/s1